Sugi Predict

Sugi Predict / Compounds / SCHEMBL4964600

SCHEMBL4964600

SCHEMBL4964600

CC(C)(C)OC(=O)Nc1cn(-c2cccnc2)nc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.47
▸ NAMPT P43490 2/20 0.46
▸ RAB9A P51151 2/20 0.42
▸ GRM5 P41594 1/20 0.41
▸ GRM1 Q13255 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.41
▸ IRAK4 Q9NWZ3 2/20 0.41
▸ METAP1 P53582 1/20 0.40
▸ ATR Q13535 1/20 0.40
▸ P2RX7 Q99572 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ BRD9 Q9H8M2 1/20 0.39
▸ SCD O00767 1/20 0.37
▸ BCL2 P10415 1/20 0.37
▸ DGAT1 O75907 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ IDO1 P14902 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29873929 1.00 HTT (0.47) HTTNAMPTRAB9AGRM5GRM1
SCHEMBL15975573 0.87 HTT (0.48) HTTNAMPTRAB9AGRM5GRM1
SCHEMBL4973615 0.86 HTT (0.47) HTTNAMPTRAB9AGRM5GRM1
SCHEMBL18019548 0.84 DGAT1 (0.48) HTTNAMPTRAB9AGRM5GRM1
SCHEMBL15356678 0.84 ATR (0.39) HTTATRP2RX7BRD9SCD
SCHEMBL16652277 0.83 SMN1; SMN2 (0.50) HTTRAB9AIRAK4MAPK1NPC1
SCHEMBL2691116 0.82 IRAK4 (0.45) HTTRAB9AIRAK4MAPK1NPC1
SCHEMBL22895199 0.81 IRAK4 (0.40) HTTIRAK4MAPK1DGAT1CYP3A4
SCHEMBL29901178 0.81 IRAK4 (0.40) HTTIRAK4MAPK1DGAT1CYP3A4
SCHEMBL15975596 0.81 ELOVL1 (0.38) ATRP2RX7BRD9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 74 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947813-A Preparation method of 3-chloro-4-amino-1- (3-pyridyl) -1H-pyrazole 绍兴贝斯美化工股份有限公司 2023-10-27 — — CN claimed
CN-117770262-A Molecules having pesticidal utility and compositions and methods related thereto 科迪华农业科技有限责任公司 2024-03-29 — — CN disclosed
CN-112778271-B Molecules having pesticidal utility and compositions and methods related thereto 科迪华农业科技有限责任公司 2023-11-28 — — CN disclosed
EP-4088577-B1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-11-08 — — EP disclosed
CN-116947813-A Preparation method of 3-chloro-4-amino-1- (3-pyridyl) -1H-pyrazole 绍兴贝斯美化工股份有限公司 2023-10-27 — — CN disclosed
US-20230322709-A1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-10-12 — — US disclosed
US-20230322709-A1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2023-10-12 — — US disclosed
EP-4209489-A1 COMPOSITIONS HAVING PESTICIDAL UTILITY Corteva Agriscience LLC (US) 2023-07-12 — — EP disclosed
US-11691961-B2 Molecule having pesticidal utility, and compositions, and processes, related thereto CORTEVA AGRISCIENCE LLC (US) 2023-07-04 — — US disclosed
US-11691961-B2 Molecule having pesticidal utility, and compositions, and processes, related thereto CORTEVA AGRISCIENCE LLC (US) 2023-07-04 — — US disclosed
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 — — US disclosed
US-20130288893-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 — — US disclosed
WO-2013162715-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 — — WO disclosed
WO-2013162716-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-10-31 — — WO disclosed
US-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 — — US disclosed
WO-2013062981-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 — — WO disclosed
US-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-05-02 — — US disclosed
WO-2012061290-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 — — WO disclosed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 — — US disclosed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130109566-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS HTT 4384/4885NAMPT 2860/4885RAB9A 980/4885
US-20230322709-A1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, PLA2G2D, MYO1G HTT 4610/4885NAMPT 3941/4885RAB9A 467/4885
US-20130291227-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS HTT 4384/4885NAMPT 2860/4885RAB9A 980/4885
US-11691961-B2 Molecule having pesticidal utility, and compositions, and processes, related thereto ACHE, DDT, UNC119 HTT 4379/4885NAMPT 3058/4885RAB9A 644/4885
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto ACHE, DDT, PTMS HTT 4384/4885NAMPT 2860/4885RAB9A 980/4885
US-20130288893-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS HTT 4384/4885NAMPT 2860/4885RAB9A 980/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.